169130-42-1
4-HYDROXY-2,2-DIMETHYL-2,3-DIHYDROBENZOFURAN-6-CARBOXYLIC ACID
Name4-HYDROXY-2,2-DIMETHYL-2,3-DIHYDROBENZOFURAN-6-CARBOXYLIC ACID
1Identification
【Name】
4-HYDROXY-2,2-DIMETHYL-2,3-DIHYDROBENZOFURAN-6-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD11226226
【English Synonyms】
【Formula】
C11 H12 O4
【MolWeight】
208.212
【Inchi】
InChI=1S/C11H12O4/c1-11(2)5-7-8(12)3-6(10(13)14)4-9(7)15-11/h3-4,12H,5H2,1-2H3,(H,13,14)
【InChIKey】
InChIKey=AVONXTUWZNEHTN-UHFFFAOYSA-N
【SMILES】
CC1(Cc2c(cc(cc2O1)C(=O)O)O)C
【MOL File】
4-HYDROXY-2,2-DIMETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-HYDROXY-2,2-DIMETHYL-2,3-DIHYDROBENZOFURAN-6-CARBOXYLIC ACID.cml